6-chloranyl-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C22H22ClN3O5/c1-29-10-7-26(13-19-24-17-6-3-2-5-15(17)21(27)25-19)22(28)14-11-16(23)20-18(12-14)30-8-4-9-31-20/h2-3,5-6,11-12H,4,7-10,13H2,1H3,(H,24,25,27)